SCHEMBL2264321

SCHEMBL2264321

NCCOC(=O)C(F)(F)F

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.32
HDAC6 Q9UBN7 1/20 0.31
HTT P42858 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2093021 0.86 HDAC6 (0.36) HDAC6
SCHEMBL28726906 0.84 CA12 (0.40) HDAC6
SCHEMBL1589356 0.84 HTT (0.35) HTT
SCHEMBL28868686 0.82 CA12 (0.42) HDAC6
SCHEMBL19857514 0.82 HTT (0.31) HTT
SCHEMBL28726935 0.81 CA1 (0.36) IDO1
SCHEMBL18774756 0.79
Ethylene SCHEMBL11404296 0.79 ALDH1A1 (0.32) HTT
SCHEMBL19379541 0.79 CES2 (0.39) HTT
SCHEMBL28903671 0.79 CES2 (0.34) HTT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114395117-B Double-end perfluoropolyether and preparation method thereof 西安近代化学研究所 2023-10-20 CN claimed
CN-114395119-B Binary copolymerization perfluoropolyether and preparation method thereof 西安近代化学研究所 2023-06-09 CN claimed
CN-114395117-A Double-end perfluoropolyether and preparation method thereof 西安近代化学研究所 2022-04-26 CN claimed
CN-114395119-A Binary copolymerization perfluoropolyether and preparation method thereof 西安近代化学研究所 2022-04-26 CN claimed
CN-114395117-B Double-end perfluoropolyether and preparation method thereof 西安近代化学研究所 2023-10-20 CN disclosed
CN-114395119-B Binary copolymerization perfluoropolyether and preparation method thereof 西安近代化学研究所 2023-06-09 CN disclosed
CN-114395119-A Binary copolymerization perfluoropolyether and preparation method thereof 西安近代化学研究所 2022-04-26 CN disclosed
CN-114395117-A Double-end perfluoropolyether and preparation method thereof 西安近代化学研究所 2022-04-26 CN disclosed
US-8426437-B2 Pyrroloquinoline derivatives and their use as protein kinases inhibitors PIERRE FABRE MEDICAMENT (FR) 2013-04-23 US disclosed
US-20110201657-A1 AMIDE SUBSTITUTED INDAZOLE AND BENZOTRIAZOLE DERIVATIVES AS POLY(ADP-RIBOSE)POLYMERASE (PARP) INHIBITORS ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) 2011-08-18 US disclosed
US-20090275619-A1 Amide Substituted Indazole and Benzotriazole Derivatives as Poly(ADP-Ribose)Polymerase (PARP) Inhibitors ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) 2009-11-05 US disclosed
US-20090042876-A1 Pyrroloquinoline Derivatives And Their Use As Protein Kinases Inhibitors PIERRE FABRE MEDICAMENT (FR) 2009-02-12 US disclosed
US-7462451-B2 Compositions for modifying nucleic acids THIRD WAVE TECHNOLOGIES, INC. (US) 2008-12-09 US disclosed
US-20050277138-A1 Reactive functional groups THIRD WAVE TECHNOLOGIES, INC. (US) 2005-12-15 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090275619-A1 Amide Substituted Indazole and Benzotriazole Derivatives as Poly(ADP-Ribose)Polymerase (PARP) Inhibitors PARP1, PARP3, PARP2 IDO1 528/4885HDAC6 470/4885HTT 834/4885
US-20110201657-A1 AMIDE SUBSTITUTED INDAZOLE AND BENZOTRIAZOLE DERIVATIVES AS POLY(ADP-RIBOSE)POLYMERASE (PARP) INHIBITORS PARP1, PARP3, PARP2 IDO1 528/4885HDAC6 470/4885HTT 834/4885
US-20090042876-A1 Pyrroloquinoline Derivatives And Their Use As Protein Kinases Inhibitors MAP3K1, MAP3K2, MAP3K7 IDO1 1964/4885HDAC6 704/4885HTT 2443/4885
US-20050277138-A1 Reactive functional groups RNGTT, POLRMT, NSUN2 IDO1 4202/4885HDAC6 1826/4885HTT 2231/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.